2-(4-phenethyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)ethanamine

Systemtic Name: 2-(4-phenethyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)ethanamine Openeye Name: 2-(5-allylsulfanyl-4-phenethyl-1,2,4-triazol-3-yl)ethanamine CAS Name: 2-[4-phenethyl-5-(prop-2-enylthio)-1,2,4-triazol-3-yl]ethanamine IUPAC Name: 2-(4-phenethyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)ethanamine Traditional Name: 2-[5-(allylthio)-4-phenethyl-1,2,4-triazol-3-yl]ethylamine Formula: C15H20N4S MolecularWeight: 288.4111

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(N1CCC2=CC=CC=C2)CCN

Isomeric SMILES

C=CCSC1=NN=C(N1CCC2=CC=CC=C2)CCN

InChI

InChI=1S/C15H20N4S/c1-2-12-20-15-18-17-14(8-10-16)19(15)11-9-13-6-4-3-5-7-13/h2-7H,1,8-12,16H2